4-p-Tolyl[1,2,4]triazole-3,5-dione

Base Information

Chemical Name:4-p-Tolyl[1,2,4]triazole-3,5-dione
CAS No.:72708-83-9
Molecular Formula:C9H7N3O2
Molecular Weight:189.173
Hs Code.:
DSSTox Substance ID:DTXSID80375283
Nikkaji Number:J464.844G
Wikidata:Q82163814
Mol file:72708-83-9.mol

Synonyms:72708-83-9;4-p-tolyl[1,2,4]triazole-3,5-dione;4-(p-Tolyl)-3H-1,2,4-triazole-3,5(4H)-dione;4-(4-methylphenyl)-1,2,4-triazole-3,5-dione;4-p-Tolyl-[1,2,4]triazole-3,5-dione;1,2,4-Triazolidine-3,5-dione, 4-(4-methylphenyl)-;SCHEMBL12631701;DTXSID80375283;AKOS006274649;BS-18015;CS-0319494;D83321;4-p-tolyl-3H-1,2,4-triazole-3,5(4H)-dione;4-(4-Methylphenyl)-4H-1,2,4-triazole-3,5-dione;4-(4-methylphenyl)-4,5-dihydro-3H-1,2,4-triazole-3,5-dione

Suppliers and Price of 4-p-Tolyl[1,2,4]triazole-3,5-dione

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Crysdot
4-(p-Tolyl)-3H-1,2,4-triazole-3,5(4H)-dione 97%
1g
$ 583.00

Ambeed
4-(p-Tolyl)-3H-1,2,4-triazole-3,5(4H)-dione 97%
1g
$ 607.00

Ambeed
4-(p-Tolyl)-3H-1,2,4-triazole-3,5(4H)-dione 97%
250mg
$ 259.00

Ambeed
4-(p-Tolyl)-3H-1,2,4-triazole-3,5(4H)-dione 97%
100mg
$ 127.00

AHH
4-p-Tolyl[1,2,4]triazole-3,5-dione 98%
1g
$ 280.00

Total 6 raw suppliers

Chemical Property of 4-p-Tolyl[1,2,4]triazole-3,5-dione

Chemical Property:

PSA：62.10000
LogP:1.44340
Storage Temp.:Inert atmosphere,Store in freezer, under -20°C
XLogP3:2.1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:189.053826475
Heavy Atom Count:14
Complexity:274

Purity/Quality:

97% ^*data from raw suppliers

4-(p-Tolyl)-3H-1,2,4-triazole-3,5(4H)-dione 97% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=CC=C(C=C1)N2C(=O)N=NC2=O

Technology Process of 4-p-Tolyl[1,2,4]triazole-3,5-dione

There total 3 articles about 4-p-Tolyl[1,2,4]triazole-3,5-dione which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 93.0%

: 79491-05-7
4-(4-methylphenyl)-1,2,4-triazolidine-3,5-dione

: 72708-83-9
4-(4-Methylphenyl)-1,2,4-triazoline-3,5-dione

Guidance literature:: With N-Bromosuccinimide; In dichloromethane; at 0 ℃; for 1h;

Reference yield:

: 35580-58-6
C₁₁H₁₅N₃O₃

: 72708-83-9
4-(4-Methylphenyl)-1,2,4-triazoline-3,5-dione

Guidance literature:: Multi-step reaction with 2 steps

1: KOH / H₂O / 2 h

2: 51 percent / anhydrous Na₂SO₄, N₂O₄ / CH₂Cl₂ / 0 °C

With dinitrogen tetraoxide; sodium sulfate; potassium hydroxide; In dichloromethane; water;
DOI:10.1021/ja00322a023

Reference yield:

: 622-58-2,374675-64-6
p-Tolylisocyanate

: 72708-83-9
4-(4-Methylphenyl)-1,2,4-triazoline-3,5-dione

Guidance literature:: Multi-step reaction with 3 steps

1: benzene / 20-25 deg C, 2 h; reflux, 2 h

2: KOH / H₂O / 2 h

3: 51 percent / anhydrous Na₂SO₄, N₂O₄ / CH₂Cl₂ / 0 °C

With dinitrogen tetraoxide; sodium sulfate; potassium hydroxide; In dichloromethane; water; benzene;
DOI:10.1021/ja00322a023